Compound Identification
SMILES
CC(C)(C)C(=O)C1=CN(C#CC(O)C2=CC=C(Br)C=C2)C2=CC=CC=C12
InChIKey
InChIKey=DPYBXMAGLRKZOU-UHFFFAOYSA-N
Formula
C22H20BrNO2
Mass
410.311
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Indoles and derivatives
- Subclass Indoles
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Class
Indoles and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
Indoles
Intermediate Tree Nodes
Not available
Direct Parent
Indoles
Alternative Parents
Aryl alkyl ketones Bromobenzenes Substituted pyrroles Aryl bromides Vinylogous amides Heteroaromatic compounds Secondary alcohols Azacyclic compounds Organonitrogen compounds Organobromides Organic oxides Hydrocarbon derivatives Aromatic alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indole - Aryl ketone - Aryl alkyl ketone - Bromobenzene - Halobenzene - Aryl bromide - Benzenoid - Aryl halide - Substituted pyrrole - Monocyclic benzene moiety - Vinylogous amide - Heteroaromatic compound - Pyrrole - Secondary alcohol - Ketone - Azacycle - Hydrocarbon derivative - Organobromide - Organohalogen compound - Organonitrogen compound - Organic nitrogen compound - Alcohol - Organooxygen compound - Aromatic alcohol - Organic oxygen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indoles. These are compounds containing an indole moiety, which consists of pyrrole ring fused to benzene to form 2,3-benzopyrrole.
External Descriptors
Not available